COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.696  -1.016  -1.890  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.503  -0.177  -1.117  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.912   0.516  -0.057  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.557   0.348   0.186  1.00  0.00           C  
HETATM    5  N   UNL     1       0.171  -0.460  -0.565  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.348  -1.129  -1.580  1.00  0.00           C  
HETATM    7  O   UNL     1       0.026   1.016   1.212  1.00  0.00           O  
HETATM    8  O   UNL     1       0.444  -1.941  -2.324  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.946  -0.027  -1.414  1.00  0.00           C  
HETATM   10  O   UNL     1      -4.442  -0.637  -2.339  1.00  0.00           O  
HETATM   11  O   UNL     1      -4.707   0.785  -0.657  1.00  0.00           O  
HETATM   12  C   UNL     1       1.045  -1.155  -3.257  1.00  0.00           C  
HETATM   13  C   UNL     1       0.695   0.177  -3.368  1.00  0.00           C  
HETATM   14  C   UNL     1       1.311   0.979  -4.330  1.00  0.00           C  
HETATM   15  C   UNL     1       2.284   0.435  -5.169  1.00  0.00           C  
HETATM   16  C   UNL     1       2.633  -0.893  -5.051  1.00  0.00           C  
HETATM   17  C   UNL     1       2.018  -1.692  -4.098  1.00  0.00           C  
HETATM   18  C   UNL     1       0.936   2.404  -4.456  1.00  0.00           C  
HETATM   19  N   UNL     1       0.110   2.939  -3.601  1.00  0.00           N  
HETATM   20  N   UNL     1       1.460   3.167  -5.478  1.00  0.00           N  
HETATM   21  O   UNL     1       2.364  -3.001  -3.985  1.00  0.00           O  
HETATM   22  C   UNL     1      -0.010   0.189   2.291  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.476  -1.111   2.152  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.515  -1.956   3.246  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.092  -1.512   4.482  1.00  0.00           C  
HETATM   26  C   UNL     1       0.377  -0.206   4.630  1.00  0.00           C  
HETATM   27  C   UNL     1       0.422   0.643   3.525  1.00  0.00           C  
HETATM   28  C   UNL     1       0.832   0.272   5.954  1.00  0.00           C  
HETATM   29  N   UNL     1       0.943  -0.485   7.083  1.00  0.00           N  
HETATM   30  N   UNL     1       1.203   1.500   6.242  1.00  0.00           N  
HETATM   31  C   UNL     1       1.545   1.565   7.534  1.00  0.00           C  
HETATM   32  C   UNL     1       1.395   0.340   8.076  1.00  0.00           C  
HETATM   33  H   UNL     1      -2.115  -1.569  -2.718  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.503   1.174   0.562  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.650   0.883  -0.851  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.057   0.595  -2.716  1.00  0.00           H  
HETATM   37  H   UNL     1       2.764   1.055  -5.912  1.00  0.00           H  
HETATM   38  H   UNL     1       3.386  -1.312  -5.701  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.197   2.425  -2.839  1.00  0.00           H  
HETATM   40  H   UNL     1       1.158   4.080  -5.605  1.00  0.00           H  
HETATM   41  H   UNL     1       2.133   2.792  -6.067  1.00  0.00           H  
HETATM   42  H   UNL     1       3.091  -3.044  -3.349  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.809  -1.463   1.187  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.879  -2.966   3.132  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.124  -2.174   5.334  1.00  0.00           H  
HETATM   46  H   UNL     1       0.784   1.654   3.634  1.00  0.00           H  
HETATM   47  H   UNL     1       0.741  -1.430   7.165  1.00  0.00           H  
HETATM   48  H   UNL     1       1.888   2.448   8.053  1.00  0.00           H  
HETATM   49  H   UNL     1       1.593   0.063   9.101  1.00  0.00           H  
CONECT    1    2    2    6   33                                       
CONECT    2    1    1    3    9                                       
CONECT    3    2    4    4   34                                       
CONECT    4    3    3    5    7                                       
CONECT    5    4    6    6                                            
CONECT    6    1    5    5    8                                       
CONECT    7    4   22                                                 
CONECT    8    6   12                                                 
CONECT    9    2   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   35                                                 
CONECT   12    8   13   13   17                                       
CONECT   13   12   12   14   36                                       
CONECT   14   13   15   15   18                                       
CONECT   15   14   14   16   37                                       
CONECT   16   15   17   17   38                                       
CONECT   17   12   16   16   21                                       
CONECT   18   14   19   19   20                                       
CONECT   19   18   18   39                                            
CONECT   20   18   40   41                                            
CONECT   21   17   42                                                 
CONECT   22    7   23   23   27                                       
CONECT   23   22   22   24   43                                       
CONECT   24   23   25   25   44                                       
CONECT   25   24   24   26   45                                       
CONECT   26   25   27   27   28                                       
CONECT   27   22   26   26   46                                       
CONECT   28   26   29   30   30                                       
CONECT   29   28   32   47                                            
CONECT   30   28   28   31                                            
CONECT   31   30   32   32   48                                       
CONECT   32   29   31   31   49                                       
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   23                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   29                                                      
CONECT   48   31                                                      
CONECT   49   32                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
